(phenylmethyl) N-[3-chloranyl-1-oxidanylidene-1-(pyrrol-1-ylamino)propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-chloranyl-1-oxidanylidene-1-(pyrrol-1-ylamino)propan-2-yl]carbamate Openeye Name: benzyl N-[1-(chloromethyl)-2-oxo-2-(pyrrol-1-ylamino)ethyl]carbamate CAS Name: N-[3-chloro-1-oxo-1-(1-pyrrolylamino)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-chloro-1-oxo-1-(pyrrol-1-ylamino)propan-2-yl]carbamate Traditional Name: N-[1-(chloromethyl)-2-keto-2-(pyrrol-1-ylamino)ethyl]carbamic acid benzyl ester Formula: C15H16ClN3O3 MolecularWeight: 321.75884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCl)C(=O)NN2C=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCl)C(=O)NN2C=CC=C2

InChI

InChI=1S/C15H16ClN3O3/c16-10-13(14(20)18-19-8-4-5-9-19)17-15(21)22-11-12-6-2-1-3-7-12/h1-9,13H,10-11H2,(H,17,21)(H,18,20)